SCHEMBL11449458

SCHEMBL11449458

CC(C)Cc1nnc(S(=O)(=O)F)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GSK3B P49841 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12438140 0.75
SCHEMBL11449539 0.74 GLA (0.39) KDM4E
SCHEMBL9984732 0.73
SCHEMBL11448816 0.73 SMN1; SMN2 (0.31)
SCHEMBL11447631 0.73
SCHEMBL11448799 0.72
SCHEMBL11448128 0.72 PARP1 (0.37) ALDH1A1GSK3B
SCHEMBL11457760 0.70 GPR84 (0.38) ALDH1A1
SCHEMBL11449338 0.69 GPR84 (0.40) ALDH1A1
SCHEMBL11448252 0.69

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4226873-A 5-Substituted-3-fluorosulfonyl-4H-1,2,4-triazoles and use as insecticides and miticides GULF OIL CORPORATION (US) 1980-10-07 US claimed